In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2005 | 20 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.12 | 7.61 | -8.71 | 1 | 4 | 0 | 47 | 271.364 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 8.13 | -29.61 | 2 | 4 | 1 | 48 | 272.372 | 6 | ↓ |